N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-4-iodanyl-1-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-4-iodanyl-1-methyl-pyrazole-3-carboxamide Openeye Name: N-[3-(4-chlorophenoxy)-5-nitro-phenyl]-4-iodo-1-methyl-pyrazole-3-carboxamide CAS Name: N-[3-(4-chlorophenoxy)-5-nitrophenyl]-4-iodo-1-methyl-3-pyrazolecarboxamide IUPAC Name: N-[3-(4-chlorophenoxy)-5-nitrophenyl]-4-iodo-1-methylpyrazole-3-carboxamide Traditional Name: N-[3-(4-chlorophenoxy)-5-nitro-phenyl]-4-iodo-1-methyl-pyrazole-3-carboxamide Formula: C17H12ClIN4O4 MolecularWeight: 498.65905

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-])I

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)Cl)[N+](=O)[O-])I

InChI

InChI=1S/C17H12ClIN4O4/c1-22-9-15(19)16(21-22)17(24)20-11-6-12(23(25)26)8-14(7-11)27-13-4-2-10(18)3-5-13/h2-9H,1H3,(H,20,24)